X-ray-absorption spectroscopy in CoSi 2 and NiSi 2 : Experiment and theory

作者: P. Lerch , T. Jarlborg , V. Codazzi , G. Loupias , A. M. Flank

DOI: 10.1103/PHYSREVB.45.11481

关键词:

摘要: This paper presents an experimental and theoretical study of x-ray-absorption spectroscopy near the edge. We measured K edges for all atom types ${\mathit{L}}_{2,3}$ Co Ni. Theoretical spectra from a linear-muffin-tin-orbitals band-structure calculation are shown. The effect core hole on threshold energies absorption has been studied. also show distribution photoelectron in elementary cell. Threshold obtained by using difference-self-consistent-field method compared to values. Polarization energies, due rearrangement orbitals, have estimated different holes.

参考文章(43)
O Bisi, C Calandra, Transition metal silicides: aspects of the chemical bond and trends in the electronic structure Journal of Physics C: Solid State Physics. ,vol. 14, pp. 5479- 5494 ,(1981) , 10.1088/0022-3719/14/35/008
J. Tersoff, D. R. Hamann, Bonding and structure of CoSi2and NiSi2 Physical Review B. ,vol. 28, pp. 1168- 1170 ,(1983) , 10.1103/PHYSREVB.28.1168
J. H. Weaver, A. Franciosi, V. L. Moruzzi, Bonding in metal disilicides Ca Si 2 through Ni Si 2 : Experiment and theory Physical Review B. ,vol. 29, pp. 3293- 3302 ,(1984) , 10.1103/PHYSREVB.29.3293
J Robertson, Electronic structure of Ni and other transition-metal silicide overlayers on Si Journal of Physics C: Solid State Physics. ,vol. 18, pp. 947- 959 ,(1985) , 10.1088/0022-3719/18/4/023
Xu Jian-hua, Xu Yong-nian, Electronic structures and charge transfer of nickel silicides Solid State Communications. ,vol. 55, pp. 891- 893 ,(1985) , 10.1016/0038-1098(85)90201-7
R Sen Gupta, S Chatterjee, Electronic and optical properties of CoSi2 Journal of Physics F: Metal Physics. ,vol. 16, pp. 733- 738 ,(1986) , 10.1088/0305-4608/16/6/009
Walter R. L. Lambrecht, Niels E. Christensen, Peter Blöchl, Electronic structure and properties of NiSi 2 and CoSi 2 in the fluorite and adamantane structures Physical Review B. ,vol. 36, pp. 2493- 2503 ,(1987) , 10.1103/PHYSREVB.36.2493
L. F. Mattheiss, D. R. Hamann, Electronic structure and properties of CoSi2. Physical Review B. ,vol. 37, pp. 10623- 10627 ,(1988) , 10.1103/PHYSREVB.37.10623
Keith L. Peterson, J. S. Hsiao, D. R. Chopra, T. R. Dillingham, Calculations of the local density of states of NiSi 2 , NiSi, Ni 2 Si, and Ni 3 Si using the Haydock recursion method Physical Review B. ,vol. 38, pp. 9511- 9516 ,(1988) , 10.1103/PHYSREVB.38.9511
J. S. Hsiao, Keith L. Peterson, Haydock recursion-method calculations of the local density of states of NiSi 2 and Ni 3 Si Physical Review B. ,vol. 38, pp. 10911- 10914 ,(1988) , 10.1103/PHYSREVB.38.10911